SCHEMBL1243336

SCHEMBL1243336

CC(C)([K])c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 3/20 0.46
TAAR1 Q96RJ0 1/20 0.46
ALOX15 P16050 1/20 0.46
ESR1 P03372 2/20 0.44
ESR2 Q92731 2/20 0.44
CYP3A4 P08684 1/20 0.44
KCNN4 O15554 4/20 0.43
TSHR P16473 2/20 0.43
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
CYP2B6 P20813 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL430941 0.73 ESR1 (0.70) MAPK1ALDH1A1TAAR1ALOX15ESR1
Tert-Butylbenzene SCHEMBL337648 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL14910456 0.73 ESR1 (0.70) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL35881 0.73 ESR1 (0.70) MAPK1ALDH1A1TAAR1ALOX15ESR1
Tert-Butylbenzene SCHEMBL18889 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL297878 0.73 KCNN4 (0.47) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL96177 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
Tert-Butylbenzene SCHEMBL22264599 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
Tert-Butylbenzene SCHEMBL22264597 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1
SCHEMBL1058732 0.73 MAPK1 (0.55) MAPK1ALDH1A1TAAR1ALOX15ESR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 201 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024066848-A1 HIGH-MOLECULAR-WEIGHT NARROW-DISTRIBUTION PHS RESIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海八亿时空先进材料有限公司 2024-04-04 WO claimed
CN-115260348-A High molecular weight and narrow distribution PHS resin and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2022-11-01 CN claimed
US-8552182-B2 Method for producing a 3-(substituted-oxy)-4-pyridazinol derivative MITSUI CHEMICALS AGRO, INC. (JP) 2013-10-08 US claimed
US-20120184736-A1 METHOD FOR PRODUCING A 3-(SUBSTITUTED-OXY)-4-PYRIDAZINOL DERIVATIVE MITSUI CHEMICALS AGRO, INC (JP) 2012-07-19 US claimed
EP-2029644-A1 POLY (VINYL ALCOHOL) POLYMERS, USES AND PREPARATION THEREOF Valorisation-Recherche, Société en Commandite (CA) 2009-03-04 EP claimed
WO-2007143848-A1 POLY (VINYL ALCOHOL) POLYMERS, USES AND PREPARATION THEREOF Valorisation-Recherche, Société en Commandite (CA) 2007-12-21 WO claimed
US-5811611-A Method for producing monoalkenyl benzene NIPPON OIL CO., LTD. (JP) 1998-09-22 US claimed
EP-0494792-B1 Tetrahydropyranyloxystyrene homopolymer and method of manufacturing the same SHINETSU CHEMICAL CO (JP) 1996-12-04 EP claimed
EP-0494791-B1 P-vinylphenoxydimethylphenyl-carbyldimethylsilane homopolymer and method of manufacturing the same SHINETSU CHEMICAL CO (JP) 1996-12-04 EP claimed
US-4565650-A Process for N-doping of polymers SOCIETE NATIONALE ELF AQUITAINE (FR) 1986-01-21 US claimed
EP-0133109-A1 Process for the N doping of polymers SOCIETE NATIONALE ELF AQUITAINE (FR) 1985-02-13 EP claimed
US-4442199-A POLYBUTADIENE OR POLYISOPRENE TOYO SODA MANUFACTURING CO., LTD. (JP) 1984-04-10 US claimed
US-4252925-A HYDROCARBYLMETAL CATALYST TOYO SODA MANUFACTURING CO., LTD. (JP) 1981-02-24 US claimed
JP-4015205-A None JP disclosed
WO-2024066848-A1 HIGH-MOLECULAR-WEIGHT NARROW-DISTRIBUTION PHS RESIN, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海八亿时空先进材料有限公司 2024-04-04 WO disclosed
US-20230399451-A1 METHOD FOR PRODUCING BLOCK COPOLYMER NIPPON SODA CO., LTD. (JP) 2023-12-14 US disclosed
US-4104455-A SOLVENT, ORGANOMETALLIC INITIATOR TOYO SODA MANUFACTURING CO., LTD. (JP) 1978-08-01 US disclosed
US-4059554-A Stabilized emulsion inks XEROX CORPORATION (US) 1977-11-22 US disclosed
US-4032628-A COSMETIC EMULSION COMPOSITIONS INCLUDING BLACK POLYMER EMULSIFIERS SOCIETE ANONYME DITE: L'OREAL (FR) 1977-06-28 US disclosed
US-4030512-A Hair lacquer or setting lotion containing bi- or tri-sequenced copolymer SOCIETE ANONYME DITE: L'OREAL (FR) 1977-06-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120184736-A1 METHOD FOR PRODUCING A 3-(SUBSTITUTED-OXY)-4-PYRIDAZINOL DERIVATIVE CYP4F3, CYP4F2, PNPO MAPK1 3060/4885ALDH1A1 603/4885TAAR1 1813/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.